2-(6-((tert-Butoxycarbonyl)amino)-9H-purin-9-yl)acetic acid

Name: 2-(6-((tert-Butoxycarbonyl)amino)-9H-purin-9-yl)acetic acid
Brand: ChemScene
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CAS No. 186046-99-1
Cat. No. CS-0699130
Purity≥98%
MDL No.MFCD24465997

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2-(6-((tert-Butoxycarbonyl)amino)-9H-purin-9-yl)acetic acid|CS-0699130

Structure of 186046-99-1

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Description

This purine derivative features a tert-butoxycarbonyl-protected amine and a pendant acetic acid group, enabling direct incorporation into nucleoside analogs. The orthogonal functionality supports sequential deprotection and conjugation strategies in synthetic biology workflows.

Application

2-(6-((tert-Butoxycarbonyl)amino)-9H-purin-9-yl)acetic acid serves as a versatile building block for purine-based scaffolds, enabling straightforward access to nucleoside analogs and kinase inhibitors. The Boc-protected amine ensures stability during synthetic manipulations, while the pendant acetic acid facilitates conjugation via amide or ester formation. Its bench-stable nature and compatibility with standard coupling protocols make it ideal for medicinal chemistry campaigns requiring selective functionalization of purine cores.

General Information

CAS No. 186046-99-1
Cat. No. CS-0699130
Purity ≥98%
MDL No. MFCD24465997
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₅N₅O₄
Molecular Weight 293.28
Synonym(s) None
SMILES CC(C)(C)OC(=O)NC1=C2N=CN(CC(O)=O)C2=NC=N1

Computational Chemistry Data

TPSA 119.23
LogP 1.2579
H_Acceptors 7
H_Donors 2
Rotatable_Bonds 3

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic heterocycle compounds Purine compounds

Key Words

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2-(6-((tert-Butoxycarbonyl)amino)-9H-purin-9-yl)acetic acid

CAS No. 186046-99-1

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